Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 2/20 | 0.48 |
| ▸ | CDC7 | O00311 | 1/20 | 0.48 |
| ▸ | EEF2K | O00418 | 1/20 | 0.48 |
| ▸ | PLK4 | O00444 | 1/20 | 0.48 |
| ▸ | AURKA | O14965 | 1/20 | 0.48 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.48 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.48 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.48 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.48 |
| ▸ | PIM1 | P11309 | 1/20 | 0.48 |
| ▸ | PHKG2 | P15735 | 1/20 | 0.48 |
| ▸ | AKT1 | P31749 | 1/20 | 0.48 |
| ▸ | AKT2 | P31751 | 1/20 | 0.48 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.48 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.48 |
| ▸ | GSK3A | P49840 | 1/20 | 0.48 |
| ▸ | GSK3B | P49841 | 1/20 | 0.48 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.48 |
| ▸ | PRKX | P51817 | 1/20 | 0.48 |
| ▸ | NEK2 | P51955 | 1/20 | 0.48 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8316242 | 0.81 | SMN1; SMN2 (0.54) | ALDH1A1LMNASMN1; SMN2MAPK1GAA | |
| SCHEMBL8313217 | 0.80 | CDC7 (0.64) | CDK2CDC7EEF2KPLK4AURKA | |
| SCHEMBL8315672 | 0.80 | ALDH1A1 (0.46) | CDK2CDC7EEF2KPLK4AURKA | |
| SCHEMBL8313727 | 0.76 | HSPD1 (0.59) | CDK2CDC7EEF2KPLK4AURKA | |
| SCHEMBL15647028 | 0.75 | IDH1 (0.66) | CDK2NPSR1CDK1CCNB1CCNA2 | |
| SCHEMBL15646923 | 0.75 | ALDH1A1 (0.73) | CDK2ALDH1A1LMNASMN1; SMN2HTT | |
| SCHEMBL3319329 | 0.75 | MAPT (0.59) | ALDH1A1GAATSHRMEN1KMT2A | |
| SCHEMBL8316183 | 0.73 | KMT2A (0.45) | LMNAHTTMEN1KMT2AMAPT | |
| SCHEMBL15647514 | 0.72 | KMT2A (0.75) | CDK2ALDH1A1LMNASMN1; SMN2MAPK1 | |
| SCHEMBL8316197 | 0.72 | SMN1; SMN2 (0.50) | ALDH1A1LMNASMN1; SMN2HTTMAPK1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0733626-B1 | N-(Benzofuranazyl)-arylsulphonamides and their analogues useful as endothelin-receptor-antagonists | MERCK PATENT GMBH (DE) | 1999-01-13 | — | — | EP | disclosed |
| US-5726194-A | Endothelin receptor antagonists | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-03-10 | — | — | US | disclosed |
| EP-0733626-A1 | N-(Benzofuranazyl)-arylsulphonamides and their analogues useful as endothelin-receptor-antagonists | MERCK PATENT GmbH (DE) | 1996-09-25 | — | — | EP | disclosed |